1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide

C16H26N2O2 — CID 23474990

IUPAC1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide
SMILESCN(C)C(=O)C1CC=CCC1C(=O)NC1CCCCC1
InChIInChI=1S/C16H26N2O2/c1-18(2)16(20)14-11-7-6-10-13(14)15(19)17-12-8-4-3-5-9-12/h6-7,12-14H,3-5,8-11H2,1-2H3,(H,17,19)
InChIKeyOPOWASGJDWIDEQ-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.11
Rot. Bonds3

About 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide

1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide (PubChem CID 23474990) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide
PubChem CID23474990
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide
SMILESCN(C)C(=O)C1CC=CCC1C(=O)NC1CCCCC1
InChIInChI=1S/C16H26N2O2/c1-18(2)16(20)14-11-7-6-10-13(14)15(19)17-12-8-4-3-5-9-12/h6-7,12-14H,3-5,8-11H2,1-2H3,(H,17,19)
InChIKeyOPOWASGJDWIDEQ-UHFFFAOYSA-N
XLogP2.11
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1S,6R)-6-(cyclopropylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
CID 40569411
1-N,2-N-dicyclohexylcyclopropane-1,2-dicarboxamide
CID 109132364
2-N-cycloheptyl-1-N-cyclopentylcyclopropane-1,2-dicarboxamide
CID 109132055
acetic acid;3-cyclohexyl-1,1-dimethylurea;ethane
CID 142518956
(1S,6S)-6-[(4-methylcyclohexyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 51427698
2,3,3-trichloroprop-2-enyl (1S,6S)-6-(cycloheptylcarbamoyl)cyclohex-3-ene-1-carboxylate
CID 40538947
(1R,2S)-1-N-[(1R)-cyclohex-3-en-1-yl]-2-N-[(1S)-cyclohex-3-en-1-yl]cyclohex-4-ene-1,2-dicarboxamide
CID 97326490
(1S,6R)-6-[(4-hydroxycyclohexyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 93365688
2-[[(cyclohexylamino)-(cyclopent-3-en-1-ylamino)methylidene]amino]-N,N-dimethylacetamide
CID 110047214
(1S,6R)-6-[(1-acetylpiperidin-4-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 104962133
(1S,6R)-6-(piperidin-4-ylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
CID 104962268
3-cyclobutyl-1-hydroxy-1-methylurea
CID 130900785

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide?
The IUPAC name of 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide (CID 23474990) is 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide.
What is the SMILES notation for 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide?
The canonical SMILES for 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide is CN(C)C(=O)C1CC=CCC1C(=O)NC1CCCCC1.
What is the InChIKey of 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide?
The InChIKey is OPOWASGJDWIDEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-18(2)16(20)14-11-7-6-10-13(14)15(19)17-12-8-4-3-5-9-12/h6-7,12-14H,3-5,8-11H2,1-2H3,(H,17,19).
What are the key properties of 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide?
1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclohexyl-2-N,2-N-dimethylcyclohex-4-ene-1,2-dicarboxamide is sourced from PubChem (CID 23474990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).